SCHEMBL705663

SCHEMBL705663

Fc1ccc(-c2nnn[nH]2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
KDM4E B2RXH2 1/20 0.39
NOTUM Q6P988 2/20 0.36
ALDH1A1 P00352 2/20 0.36
PKM P14618 1/20 0.36
MAPK13 O15264 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
FRK P42685 1/20 0.36
MAPK9 P45984 1/20 0.36
GCGR P47871 1/20 0.36
CSNK1A1 P48729 1/20 0.36
CSNK1D P48730 1/20 0.36
GSK3B P49841 1/20 0.36
MAPK12 P53778 1/20 0.36
PTK6 Q13882 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18383407 0.89 SCN4A (0.50) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL2028396 0.89 ADH5 (0.32)
SCHEMBL13411813 0.86 ADH5 (0.36)
SCHEMBL17251287 0.85 MEN1 (0.38) NPC1RAB9AMAPK13MAPK12MAPK11
SCHEMBL17254440 0.80 ESR1 (0.33)
SCHEMBL24573393 0.80 HSD17B1 (0.42) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL12076659 0.79 MAPK14 (0.44) KDM4EMAPK14
SCHEMBL264036 0.78 NPC1 (0.42) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL595550 0.78 IDO1 (0.35)
SCHEMBL595369 0.78 PKM (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1PKM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932595-B2 VDR-silent vitamin D derivative as inhibitors of SREBP and pharmaceutical use thereof KYOTO UNIVERSITY, NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY, TEIKYO UNIVERSITY and THE UNIVERSITY OF TOKYO (JP) 2024-03-19 US disclosed
WO-2024029583-A1 NOVEL PYRAZOLE DERIVATIVE AND USE OF SAME 国立研究開発法人理化学研究所 2024-02-08 WO disclosed
US-11648234-B2 Selective androgen receptor degrader (SARD) ligands and methods of use UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-05-16 US disclosed
EP-3976577-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF University of Tennessee Research Foundation (US) 2022-04-06 EP disclosed
WO-2022061193-A1 VDR-SILENT VITAMIN D DERIVATIVE AS INHIBITORS OF SREBP AND PHARMACEUTICAL USE THEREOF KYOTO UNIVERSITY (JP) 2022-03-24 WO disclosed
US-20220081401-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2022-03-17 US disclosed
US-20220081381-A1 VDR-SILENT VITAMIN D DERIVATIVE AS INHIBITORS OF SREBP AND PHARMACEUTICAL USE THEREOF KYOTO UNIVERSITY (JP) 2022-03-17 US disclosed
US-11230523-B2 Selective androgen receptor degrader (SARD) ligands and methods of use thereof UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2022-01-25 US disclosed
CN-113164435-A Selective Androgen Receptor Degrader (SARD) ligands and methods of use thereof 田纳西大学研究基金会 2021-07-23 CN disclosed
US-20210196678-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2021-07-01 US disclosed
US-6277998-B1 REACTING 2-CYANO-4-OXO-4H-BENZOPYRAN COMPOUND WITH HYDROGEN SULFIDE AND THEN REACTING PROUDCT WITH ALKYL HALIDE; REACTING THE PRODUCT WITH HYDRAZINE OR ITS SALT AND THEN WITH NITROUS ACID COMPOUND TO OBTAIN TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-21 US disclosed
US-6191289-B1 REACTING A 4-OXO-4H-BENZOPYRAN GROUP SUBSTITUTED WITH AMIDE OR A PHENYL GROUP IN ITS 2 POSITION IS REACTED WITH ANHYDROUS HYDRAZINE OR SALT IN PRESENCE OF CATALYST FOLLOWED BY REACTING WITH NITROUS ACID OR SALT TO FORM TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-20 US disclosed
US-5874593-A SULFUR CONTAINING AMIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-23 US disclosed
US-RE35281-E ANTIDIABETIC AGENTS WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1996-06-18 US disclosed
EP-0711762-A1 PROCESS FOR PRODUCING TETRAZOLE COMPOUND AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-05-15 EP disclosed
EP-0388967-B1 Aldose reductase inhibitor WAKAMOTO PHARMA CO LTD (JP) 1995-06-28 EP disclosed
US-5055481-A Alleviate diabetic complications WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1991-10-08 US disclosed
EP-0388967-A1 Aldose reductase inhibitor Wakamoto Pharmaceutical Co., Ltd. (JP) 1990-09-26 EP disclosed
US-4647572-A Iodoallyl and iodopropargyl substituted tetrazoles and anti-microbial compositions thereof MEIJI SEIKA KAISHA, LTD. (JP) 1987-03-03 US disclosed
EP-0107859-A1 Tetrazole compounds, process for preparing the same and antibacterial and antifungal compositions containing the same as active ingredient MEIJI SEIKA KAISHA LTD. (JP) 1984-05-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11230523-B2 Selective androgen receptor degrader (SARD) ligands and methods of use thereof AR, BRCA1, AHR NPC1 4393/4885RAB9A 4203/4885SMN1; SMN2 464/4885
US-20220081401-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF AR, BRCA1, AHR NPC1 4393/4885RAB9A 4203/4885SMN1; SMN2 464/4885
US-11648234-B2 Selective androgen receptor degrader (SARD) ligands and methods of use AR, BRCA1, FSHR NPC1 4183/4885RAB9A 4305/4885SMN1; SMN2 186/4885
US-11932595-B2 VDR-silent vitamin D derivative as inhibitors of SREBP and pharmaceutical use thereof VDR, CYP24A1, CYP2R1 NPC1 206/4885RAB9A 3090/4885SMN1; SMN2 4749/4885
US-20220081381-A1 VDR-SILENT VITAMIN D DERIVATIVE AS INHIBITORS OF SREBP AND PHARMACEUTICAL USE THEREOF VDR, CYP24A1, CYP2R1 NPC1 206/4885RAB9A 3090/4885SMN1; SMN2 4749/4885
US-20210196678-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF AR, BRCA1, FSHR NPC1 4456/4885RAB9A 4448/4885SMN1; SMN2 189/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.